Name: 6-(2-chlorophenyl)-3-methyl-2-phenyl-4,5,6,7-tetrahydroindazol-4-one
SMILES:
Cc1c2c(nn1-c1ccccc1)CC(c1ccccc1Cl)CC2=OMolecular Processing
Molecular formula
C20H17ClN2O
Molecular weight
336.82
Exact mass
336.1029
XLogP
4.75
TPSA
34.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
24
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
95.15
Supplementary Information
Details werden geladen…
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